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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-29442
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 35
  • Number of elements: 3
  • Element list: ['Bi', 'Te', 'S']
  • Chemical System: Bi-S-Te
  • Density: 7.099203080525267
  • Atomic Density: 0.030909314482253758
  • Unit Cell Volume: 1132.344750644498
  • Molar Volume: 19.483255649223622
  • Full Formula: Bi14 Te13 S8
  • Reduced Formula: Bi14Te13S8
  • Formula Anonymous: A8B13C14
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3